Geometry & MOs

Info

ID:	48387
PubChem CID:	10543715
Reduced:	O3C20H32 (1)
Stoich.:	A3B20C32 (1)
Weight, g/mol:	322.204513
ΔH_f, kcal/mol:	-152.42
Dipole, Da:	1.12
IP(EA), eV:	-9.85(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-anilino-3,3-dimethyl-1-(2-phenylethyl)piperidin-2-one

Drug info:

PubChemData

Smile

COCO[C@H]1CC[C@H]2[C@@H](C1)CC[C@@H]3[C@@H]2CCC(=C)[C@H]3CCC=O

DOS

IR

Vibrations